methyl 4-([1,2,4]triazolo[4,3-c]quinazolin-3-ylsulfanylmethyl)benzoate

Systemtic Name: methyl 4-([1,2,4]triazolo[4,3-c]quinazolin-3-ylsulfanylmethyl)benzoate Openeye Name: methyl 4-([1,2,4]triazolo[4,3-c]quinazolin-3-ylsulfanylmethyl)benzoate CAS Name: 4-[([1,2,4]triazolo[4,3-c]quinazolin-3-ylthio)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-([1,2,4]triazolo[4,3-c]quinazolin-3-ylsulfanylmethyl)benzoate Traditional Name: 4-[([1,2,4]triazolo[4,3-c]quinazolin-3-ylthio)methyl]benzoic acid methyl ester Formula: C18H14N4O2S MolecularWeight: 350.39436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSC2=NN=C3N2C=NC4=CC=CC=C43

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC2=NN=C3N2C=NC4=CC=CC=C43

InChI

InChI=1S/C18H14N4O2S/c1-24-17(23)13-8-6-12(7-9-13)10-25-18-21-20-16-14-4-2-3-5-15(14)19-11-22(16)18/h2-9,11H,10H2,1H3